2FAV
Crystal structure of SARS macro domain in complex with ADP-ribose at 1.8 A resolution
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2005-03-16 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 0.9792 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 37.451, 55.553, 108.926 |
Unit cell angles | 90.00, 91.39, 90.00 |
Refinement procedure
Resolution | 111.800 - 1.800 |
R-factor | 0.164 |
Rwork | 0.162 |
R-free | 0.20600 |
Structure solution method | SAD |
RMSD bond length | 0.016 |
RMSD bond angle | 1.511 |
Data reduction software | MOSFLM |
Data scaling software | CCP4 ((SCALA)) |
Phasing software | SOLVE |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 111.800 | 1.847 |
High resolution limit [Å] | 1.800 | 1.800 |
Number of reflections | 41654 | |
<I/σ(I)> | 17.7 | 7.1 |
Completeness [%] | 99.9 | 99.97 |
Redundancy | 10.4 | 8.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.9 | 293 | 0.1 M Imidazole, 0.9 M NaCitrate, pH 7.9, VAPOR DIFFUSION, HANGING DROP, temperature 293K |